Mol:EEL1044
Copyright: ARM project http://www.metabolome.jp/
97 99 0 0 0 0 0 0 0 0999 V2000 -13.3156 -2.0727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7046 -1.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0508 1.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1555 3.1865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5179 -1.3752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7073 -0.4036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0156 2.9581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3814 3.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6671 2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9527 3.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2381 2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5704 1.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8561 2.1211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1417 1.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4272 2.1211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7126 1.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6838 -1.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0494 -1.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3351 -1.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6207 -1.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9062 -1.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1919 -1.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5372 -1.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -1.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1085 -1.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3939 -1.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6796 -1.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6671 2.1450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5704 0.8664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7126 0.8664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3351 -2.7744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5372 -2.7744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6796 -2.7744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0017 2.1212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -1.5196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0204 -3.3998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2056 -3.3849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8003 0.0511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1894 -0.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5302 -1.7319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6136 0.2310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8032 -0.7405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3905 -1.5037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7562 -1.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0419 -1.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3276 -1.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6129 -1.5336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8986 -1.9460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1841 -1.5338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4698 -1.9463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7552 -1.5341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0408 -1.9466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3264 -1.5344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6122 -1.9468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8977 -1.5346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1833 -1.9471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4687 -1.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7794 0.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1452 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4307 0.7876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7164 0.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0018 0.7873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2876 0.3748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2928 2.1064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5787 1.6939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 2.1062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1495 1.6936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4352 2.1059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0418 -0.6908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1839 -0.6914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3263 -0.6919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4685 -0.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4305 1.6298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2926 2.9486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 2.9481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7544 -1.9474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7207 1.6933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3910 -1.9446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0266 1.6434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0266 0.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7404 0.4053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4557 0.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4557 1.6434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6918 -1.5068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9630 -1.8934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3615 -2.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2638 -1.4556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7217 2.1543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7217 2.9788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0079 3.3925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2926 2.9788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2926 2.1543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4365 3.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1435 -3.3849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0814 -3.3849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3156 0.6954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0153 1.4637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 2 6 1 0 2 5 1 0 7 4 1 0 8 7 1 0 9 8 1 0 10 9 1 0 11 10 1 0 13 12 1 0 14 13 1 0 15 14 1 0 16 15 1 0 18 17 1 0 19 18 1 0 20 19 1 0 21 20 1 0 22 21 1 0 24 23 1 0 25 24 1 0 26 25 1 0 27 26 1 0 5 17 1 0 9 28 1 0 12 29 1 0 16 30 1 0 19 31 1 0 23 32 1 0 27 33 1 0 16 34 1 0 27 35 1 0 1 36 1 0 36 37 1 0 38 39 1 0 39 40 1 0 38 42 1 0 38 41 1 0 43 40 1 0 44 43 1 0 45 44 1 0 46 45 1 0 47 46 1 0 48 47 1 0 49 48 1 0 50 49 1 0 51 50 1 0 52 51 1 0 53 52 1 0 54 53 1 0 55 54 1 0 56 55 1 0 57 56 1 0 59 58 1 0 60 59 1 0 61 60 1 0 62 61 1 0 63 62 1 0 65 64 1 0 66 65 1 0 67 66 1 0 68 67 1 0 41 58 1 0 45 69 1 0 49 70 1 0 53 71 1 0 57 72 1 0 60 73 1 0 64 74 1 0 68 75 1 0 57 76 1 0 68 77 1 0 34 77 1 0 35 76 1 0 22 78 1 0 79 80 1 0 80 81 1 0 81 82 1 0 82 83 1 0 79 83 1 0 64 79 1 0 63 82 1 0 78 84 1 0 84 85 1 0 78 86 1 0 85 87 1 0 87 23 1 0 88 89 1 0 89 90 1 0 90 91 1 0 91 92 1 0 88 92 1 0 12 92 1 0 89 93 1 0 11 93 1 0 37 94 1 0 94 95 1 0 38 96 1 0 96 97 1 0
A 37 Glc A 94 Glc A 95 Glc S SKP 6 AUTODRAW FALSE ID EEL1044 FORMULA C89H174O6 EXACTMASS 1339.3310433000001 AVERAGEMASS 1340.33026 SMILES C(C(C)2)CCC(C)CCCC(C)CCCC(CCOCC([H])(OCCC(CCCC(C3)CC(C3)C(CCCC(C)CCC(CCCC(C)C(C1)CCC1CCCC(CCOCC(OCCC(C)CCCC(CCCC(C)CCCC(CC2)C)C)([H])COCCC)C)C)C)C)CO)C M END
